4-ethyl-2,5-dimethyl-1H-imidazole

C7H12N2 — CID 15724086

IUPAC4-ethyl-2,5-dimethyl-1H-imidazole
SMILESCCc1nc(C)[nH]c1C
InChIInChI=1S/C7H12N2/c1-4-7-5(2)8-6(3)9-7/h4H2,1-3H3,(H,8,9)
InChIKeyNELFWLUXURRZAY-UHFFFAOYSA-N
MW124.19 g/mol
LogP1.59
Rot. Bonds1

About 4-ethyl-2,5-dimethyl-1H-imidazole

4-ethyl-2,5-dimethyl-1H-imidazole (PubChem CID 15724086) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is 4-ethyl-2,5-dimethyl-1H-imidazole.

Molecular Properties

Compound Name4-ethyl-2,5-dimethyl-1H-imidazole
PubChem CID15724086
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name4-ethyl-2,5-dimethyl-1H-imidazole
SMILESCCc1nc(C)[nH]c1C
InChIInChI=1S/C7H12N2/c1-4-7-5(2)8-6(3)9-7/h4H2,1-3H3,(H,8,9)
InChIKeyNELFWLUXURRZAY-UHFFFAOYSA-N
XLogP1.59
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2,5-dimethyl-1H-imidazole?
The IUPAC name of 4-ethyl-2,5-dimethyl-1H-imidazole (CID 15724086) is 4-ethyl-2,5-dimethyl-1H-imidazole.
What is the SMILES notation for 4-ethyl-2,5-dimethyl-1H-imidazole?
The canonical SMILES for 4-ethyl-2,5-dimethyl-1H-imidazole is CCc1nc(C)[nH]c1C.
What is the InChIKey of 4-ethyl-2,5-dimethyl-1H-imidazole?
The InChIKey is NELFWLUXURRZAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c1-4-7-5(2)8-6(3)9-7/h4H2,1-3H3,(H,8,9).
What are the key properties of 4-ethyl-2,5-dimethyl-1H-imidazole?
4-ethyl-2,5-dimethyl-1H-imidazole has a molecular weight of 124.19 g/mol, XLogP of 1.59, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2,5-dimethyl-1H-imidazole is sourced from PubChem (CID 15724086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).